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	hartrees
Energy at 0K	-3629.750071
Energy at 298.15K	-3629.753784
HF Energy	-3628.741462
Nuclear repulsion energy	523.534104

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1159	1082	195.15
2	A'	835	779	240.54
3	A'	516	482	1.90
4	A'	349	326	0.05
5	A'	313	292	0.09
6	A'	224	209	0.08
7	A"	880	821	220.30
8	A"	409	382	0.18
9	A"	210	196	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.530	0.126	0.000
Br2	-1.408	0.334	0.000
F3	1.072	1.344	0.000
Cl4	1.072	-0.722	1.460
Cl5	1.072	-0.722	-1.460

	C1	Br2	F3	Cl4	Cl5
C1		1.9483	1.3333	1.7727	1.7727
Br2	1.9483		2.6770	3.0646	3.0646
F3	1.3333	2.6770		2.5291	2.5291
Cl4	1.7727	3.0646	2.5291		2.9192
Cl5	1.7727	3.0646	2.5291	2.9192

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	107.855	Br2	C1	Cl4	110.808
Br2	C1	Cl5	110.808	F3	C1	Cl4	108.197
F3	C1	Cl5	108.197	Cl4	C1	Cl5	110.853

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)

using model chemistry: MP3=FULL/TZVP

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CBrCl2F (bromodichlorofluoromethane)

using model chemistry: MP3=FULL/TZVP

States and conformations

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)